BAS 01217001
TL;DR: BAS 01217001 (CAS 499191-77-4) is a chemical compound with molecular formula C26H20N2O6 and molecular weight 456.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5,12-bis(2-hydroxyphenyl)-5,12-diazapentacyclo[7.5.2.02,8.03,7.010,14]hexadec-15-ene-4,6,11,13-tetrone
Also Known As: BAS 01217001, 2,6-bis(2-hydroxyphenyl)-4,4a,7a,8,8a,8b-hexahydro-4,8-ethenopyrrolo[3',4':3,4]cyclobuta[1,2-f]isoindole-1,3,5,7(2H,3aH,3bH,6H)-tetraone, 2,6-bis(2-hydroxyphenyl)octahydro-4,8-ethenopyrrolo[3',4':3,4]cyclobuta[1,2-f]isoindole-1,3,5,7(2H,6H)-tetrone
| Molecular Formula | C26H20N2O6 |
|---|---|
| Molecular Weight | 456.13 g/mol |
| LogP | 2.071 |
| Topological Polar Surface Area | 115.22 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 456.13214 |
| Heavy Atoms | 34 |
| Complexity | 1294.3062 |
Chemical Identifiers
| CAS Number | 499191-77-4 |
|---|---|
| SMILES | C1=CC=C(C(=C1)N2C(=O)C3C4C=CC(C3C2=O)C5C4C6C5C(=O)N(C6=O)C7=CC=CC=C7O)O |
Product Overview
BAS 01217001 (CAS 499191-77-4), with molecular formula C26H20N2O6 and molecular weight 456.13 g/mol. IUPAC: 5,12-bis(2-hydroxyphenyl)-5,12-diazapentacyclo[7.5.2.02,8.03,7.010,14]hexadec-15-ene-4,6,11,13-tetrone.
Chemical Property Profile of BAS 01217001
Property Insights of BAS 01217001
The XLogP value of 2.071 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 01217001. The TPSA of 115.22 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 01217001. Following Lipinski's Rule of Five, BAS 01217001 has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 01217001?
The CAS number of BAS 01217001 is 499191-77-4.
What is the molecular formula of BAS 01217001?
The molecular formula of BAS 01217001 is C26H20N2O6.
What is the molecular weight of BAS 01217001?
The molecular weight of BAS 01217001 is 456.13 g/mol.
Where can I buy BAS 01217001?
You can request a quote for BAS 01217001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 01217001?
Yes, KEHONG BIO provides custom synthesis services for BAS 01217001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.